⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL12715224 | 0.91 | KDM4E (0.31) | — | |
| SCHEMBL12744322 | 0.90 | — | — | |
| SCHEMBL12715205 | 0.89 | ALDH1A1 (0.30) | — | |
| SCHEMBL13877518 | 0.87 | — | — | |
| SCHEMBL12715202 | 0.85 | — | — | |
| SCHEMBL12715229 | 0.83 | — | — | |
| SCHEMBL14442045 | 0.81 | KDM4E (0.32) | — | |
| SCHEMBL12216663 | 0.80 | ALDH1A1 (0.37) | — | |
| SCHEMBL13877517 | 0.79 | — | — | |
| SCHEMBL12744382 | 0.77 | KDM4E (0.30) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7924697-B2 | Optical information recording medium, image-recording method and method of utilizing a dye | FUJIFILM CORPORATION (JP) | 2011-04-12 | — | — | US | disclosed |